CHEBI:192673 - 3-(methylsulfonyl)-2H-chromen-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3-(methylsulfonyl)-2H-chromen-2-one
ChEBI ID CHEBI:192673
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H8O4S
Net Charge 0
Average Mass 224.230
Monoisotopic Mass 224.01433
InChI InChI=1S/C10H8O4S/c1-15(12,13)9-6-7-4-2-3-5-8(7)14-10(9)11/h2-6H,1H3
InChIKey JFFGMXVRZVMCDN-UHFFFAOYSA-N
SMILES S(=O)(=O)(C1=CC=2C(OC1=O)=CC=CC2)C
Metabolite of Species Details
Valsa sordida (NCBI:txid252740) Found in Whole Organism (NCIT:C13413). See: MetaboLights Study
ChEBI Ontology
Outgoing 3-(methylsulfonyl)-2H-chromen-2-one (CHEBI:192673) is a coumarins (CHEBI:23403)
IUPAC Name
3-methylsulonylchromen-2-one
Manual Xref Database
2099024 ChemSpider
View more database links